N-(1H-benzimidazol-2-yl)-2-{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(1H-benzimidazol-2-yl)-2-{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
N-(1H-benzimidazol-2-yl)-2-{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y042-4269 |
| Compound Name: | N-(1H-benzimidazol-2-yl)-2-{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C18 H17 N5 O2 S2 |
| Smiles: | Cc1c2C(NC(CSCC(Nc3nc4ccccc4[nH]3)=O)=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7818 |
| logD: | 2.7815 |
| logSw: | -3.305 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.377 |
| InChI Key: | SLXNSHUDLMOQAN-UHFFFAOYSA-N |